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In situ X-ray micro diffraction patterns measured from raw hard tissue show a very strong reflection from the (002) and (004) lattice planes on the cross-section of bone and nearly no reflection from the (002) and (004) lattice planes on elongation surface of bone. The crystallinity of HAP is poor compared with natural HAP. The domain sizes calculated from the Scherrer equation are 18.9–20.7 nm long along the c-axis and about 6.2 nm thick perpendicular to the c-axis, and is well evidenced by TEM data. Chemical composition analysis reveals that the HAP in hard tissues lacks P and is rich in Ca. The results show that the crystal phase in hard tissues of Cololabis saira is hydroxylapatite (HAP). The Direct Visualization link lets you take any simulated pattern and visualize its crystal structure in CrystalMaker, via a single menu command.X-ray micro diffractometry, transmission electron microscopy, environmental scanning electron microscopy, energy dispersive spectrometry and Fourier transform infrared were employed to investigate the crystallographic characteristics of the inorganic mineral existing in bones of Cololabis s aira. ![]() CRYSTALDIFFRACT EXPORT DIFFRACTION PATTERN PLUSYou can also export entire diffraction patterns, the reflexions list, structure factors - plus crystal structure data in CIF or CMTX formats.ĬrystalDiffract also has a direct visualization link with CrystalMaker: simply select any simulated pattern and choose the Visualize command the crystal structure will then be displayed in CrystalMaker. CRYSTALDIFFRACT EXPORT DIFFRACTION PATTERN FULLTips are expandable, to show full information on each peak, including its d-spacing, relative intensity and width.ĬrystalDiffract lets you save your work as a self-contained document, for quick and convenient access next time you use the program. Peak Tips help you identify reflexions as you move the mouse. You can browse and sort reflexions in the list double-click any reflexion to instantly locate it in the plot. Patterns can be sorted according to various criteria and auto-stacked on screen.Īn integrated Search field lets you quickly find simulated reflexions: in the plotted pattern, or in the Reflexions List. ![]() You can also specify a precise plot range, use the Scroller tool or use the toolbar's scale and scrolling commands. Just "pinch-to-zoom", and slide to scroll horizontally, or scale vertically. Scaling and scrolling your diffraction pattern is a breeze with CrystalDiffract's trackpad support. You have extensive control over the display, including pattern colours, line and marker sizes/styles, transparency, shadows, peak overlays, gridlines, film styles and colours, peak labels (including content, positioning and alignment), Legend display, plot title - plus your text fonts and sizes. Simulated mixtures can be displayed alongside the individual patterns from their components! Just use the visibility checkboxes in the Patterns List to customize your display.ĬrystalDiffract 6 provides the most beautiful displays, which you can easily copy to other programs in high-resolution vector format: copy to the clipboard, drag-and-drop into other programs, or save to file. CRYSTALDIFFRACT EXPORT DIFFRACTION PATTERN MANUALAdditional controls let you lock the mixture total or reset components to zero, for easy manual editing of phase proportions. ![]() You can adjust mixture compositions in real time, using the mixture slider and text controls in the Parameters List. Compare with simulated patterns to check for purity - or attempt a phase identification.ĬrystalDiffract lets you simulate multi-phase mixtures simply by dragging-and-dropping patterns into a mixture group. You can manipulate and rescale your observed data, apply real-time smoothing and background corrections - and then use the innovative screen tools to measure your observed pattern. Multi-processing allows for fast profile simulation, and real-time adjustment of diffraction and sample parameters: placing you firmly in control of your diffraction experiment.ĬrystalDiffract lets you import multiple experimental datasets for comparison with simulated data: just drag-and-drop text files into your diffraction window. Choose one of four preset simulation types: constant-wavelength X-rays, neutrons energy-dispersive X-rays or time-of-flight neutrons. Combine these with instant mixture creation - and the ability to load observed data in the same window - and you have a powerful workbench application for researchers, teachers and students.ĬrystalDiffract provides powerful x-ray and neutron powder diffraction simulation capabilities: but is quick and easy to use. Real-time parameter controls let you experiment with diffraction and sample settings, with instant feedback. CrystalDiffract brings the world of x-ray & neutron powder diffraction to your computer screen, with interactive control and easy characterization of your experimental data. ![]()
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